Alvimopan

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Properties Simple | Detailed

Formula C25H32N2O4
IUPAC Name 2-[[(2s)-2-benzyl-3-[(1r,3r,4r)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidyl]propanoyl]amino]acetic acid
Molecular Mass 424.533 g·mol−1
Heat of Formation -647.1 ± 16.7 kJ·mol−1
Dipole Moment 3.99 ± 1.08 D
Volume 539.42 Å 3
Surface Area 432.53 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy 0.06 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[[(2s)-2-(benzyl)-3-[(3r,4r)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidyl]propanoyl]amino]acetic acid
  • 2-[[(2s)-2-[[(3r,4r)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl]methyl]-1-oxo-3-phenylpropyl]amino]acetic acid
  • 2-[[(2s)-2-[[(3r,4r)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidyl]methyl]-3-phenyl-propanoyl]amino]acetic acid
  • 2-[[(2s)-2-[[(3r,4r)-4-(3-hydroxyphenyl)-3,4-dimethyl-piperidin-1-yl]methyl]-3-phenyl-propanoyl]amino]ethanoic acid
  • 2-[[(2s)-2-[[(3r,4r)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]methyl]-3-phenylpropanoyl]amino]acetic acid
  • alvimopan anhydrous
  • glycine, n-((2s)-2-(((3r,4r)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl)methyl)-1-oxo-3-phenylpropyl)-
  • ly246736
InChIKey UPNUIXSCZBYVBB-JVFUWBCBSA-N
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